1VMJ
CRYSTAL STRUCTURE OF A PUTATIVE THIAMIN PHOSPHATE SYNTHASE (TM0723) FROM THERMOTOGA MARITIMA MSB8 AT 1.52 A RESOLUTION
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL11-1 |
| Synchrotron site | SSRL |
| Beamline | BL11-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2001-12-09 |
| Detector | ADSC QUANTUM 315 |
| Spacegroup name | P 43 3 2 |
| Unit cell lengths | 110.194, 110.194, 110.194 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 27.550 - 1.520 |
| R-factor | 0.14495 |
| Rwork | 0.144 |
| R-free | 0.16302 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1vmf |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.358 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 27.550 | 1.600 |
| High resolution limit [Å] | 1.520 | 1.520 |
| Number of reflections | 35764 | |
| <I/σ(I)> | 19.2 | 2 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 20.5 | 8.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION,SITTING DROP,NANODROP | 6 | 293 | 3.2M (NH4)2SO4, 0.1M MES pH 6.0, VAPOR DIFFUSION,SITTING DROP,NANODROP, temperature 293K |
